Netzahualcoyone
HIT214317462
sdf文件结构编辑类似物检索
HIT ID: HIT214317462
Cas No: 87686-36-0
分子式: C30H36O6
分子量: 492.612
常用名: Netzahualcoyone
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: methyl 3,10-dihydroxy-2,4a,6,9,12b,14a-hexamethyl-4,11-dioxo-1,2,3,4,4a,5,11,12b,13,14,14a,14b-dodecahydropicene-2-carboxylate
IUPAC: methyl 3,10-dihydroxy-2,4a,6,9,12b,14a-hexamethyl-4,11-dioxo-1,2,3,4,4a,5,11,12b,13,14,14a,14b-dodecahydropicene-2-carboxylate
SMILES: COC(=O)C1(C)CC2C3(C)CCC4(C)C5=CC(=O)C(O)=C(C)C5=CC=C4C3=C(C)CC2(C)C(=O)C1O |c:23,25,t:14,19,29|
SMILES: COC(=O)C1(C)CC2C3(C)CCC4(C)C5=CC(=O)C(O)=C(C)C5=CC=C4C3=C(C)CC2(C)C(=O)C1O |c:23,25,t:14,19,29|
InChI key: JBKXDADFFNVBTG-UHFFFAOYSA-N
共显示1个结果
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